Compound Detail
CHEMBL215137
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Basic Information
| ChEMBL ID | CHEMBL215137 |
| Phase | Preclinical |
| Structure Type | MOL |
| InChI Key | PZGVJCJRMKIVLJ-DEVUXVJFSA-N |
| Parent Compound | CHEMBL80254 |
| Active Moiety | CHEMBL80254 |
3
Targets
6
Activities
2
Assay Types
0
PK Parameters
4
Publications
0
Known Names
Molecular Properties
133.2
MW (Da)
-2.33
ALogP
4
HBA
4
HBD
72.7
PSA (Ų)
0.32
QED
0
Ro5 Violations
1
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Availability | Unknown |
| Chirality | Unknown |
Activity Summary
IC50 4 meas. best 6.48
Ki 2 meas. best 6.47
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Glycogen phosphorylase, muscle form CHEMBL4696 | IC50 | 6.48 | 6.445 | 330.0 | 2 |
| Glycogen phosphorylase, muscle form CHEMBL4696 | Ki | 6.47 | 6.435 | 342.0 | 2 |
| Glycogen phosphorylase, liver form CHEMBL3239 | IC50 | 6.43 | 6.43 | 370.0 | 1 |
| Glycogen phosphorylase, liver form CHEMBL2568 | IC50 | 6.31 | 6.31 | 490.0 | 1 |
Activity Data Samples
Top measurements by pChEMBL value
| Target | Type | Rel. | Value | Units | pChEMBL | Assay | PubMed |
|---|---|---|---|---|---|---|---|
| Glycogen phosphorylase, muscle form | IC50 | = | 330.0 | nM | 6.48 | Inhibition of phosphorylated form of rabbit muscle glycogen phosphorylase | 16970395 |
| Glycogen phosphorylase, muscle form | Ki | = | 342.0 | nM | 6.47 | Inhibition of non-phosphorylated form of rabbit muscle glycogen phosphorylase in... | 16970395 |
| Glycogen phosphorylase, liver form | IC50 | = | 370.0 | nM | 6.43 | Inhibition of phosphorylated form of rat liver glycogen phosphorylase | 16970395 |
| Glycogen phosphorylase, muscle form | IC50 | = | 390.0 | nM | 6.41 | Inhibition of non-phosphorylated form of rabbit muscle glycogen phosphorylase | 16970395 |
| Glycogen phosphorylase, muscle form | Ki | = | 396.0 | nM | 6.4 | Inhibition of non-phosphorylated form of rabbit muscle glycogen phosphorylase in... | 16970395 |
| Glycogen phosphorylase, liver form | IC50 | = | 490.0 | nM | 6.31 | Inhibition of phosphorylated form of pig liver glycogen phosphorylase | 16970395 |
Literature References
| PubMed | DOI | Target Context | # Activities |
|---|---|---|---|
| 16970395 | 10.1021/jm060496g | Glycogen phosphorylase, muscle form | 4 |
| 16970395 | 10.1021/jm060496g | Glycogen phosphorylase, liver form | 2 |
| 16970395 | 10.1021/jm060496g | Liver | 1 |
| 16970395 | 10.1021/jm060496g | Mus musculus | 1 |
Data from ChEMBL 36 via Core Engine